Index

A B C D E F G H I K L M N O P Q R S T U V W X Y Z
All Classes and Interfaces|All Packages|Serialized Form

G

Ga - Enum constant in enum class qsardes.elements.ElementsEnum

Gc - Enum constant in enum class qsardes.elements.ElementsEnum

Ge - Enum constant in enum class qsardes.elements.ElementsEnum

get_all_misc_name_list() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_all_roch_electroneg() - Method in enum class qsardes.elements.ElementsEnum

Gets the Allred-Rochow atomic electronegativity.

get_aromatic_info(IAtomContainer, IAtom, IAtom) - Method in class qsardes.descriptor.DescriptorInformationContent

get_aromatic_info(IAtomContainer, IAtom, IAtom) - Method in class qsardes.descriptor.qsarme.QsarMEInformationContent

get_aromatic_info(IAtomContainer, IAtom, IAtom) - Method in class qsardes.descriptor.qsarwb.QsarWBInformationContent

get_atom_container() - Method in class qsardes.molecule.AbstractMoleculeBuilder

get_atom_container() - Method in class qsardes.molecule.Molecule

Gets the molecular CDK atom container.

get_atom_count() - Method in class qsardes.molecule.AbstractMoleculeBuilder

get_atom_num() - Method in enum class qsardes.elements.ElementsEnum

Gets the atomic number.

get_bond_count() - Method in class qsardes.molecule.AbstractMoleculeBuilder

get_chem_estate_values_map() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_default_value() - Method in class qsardes.descriptor.DescriptorAutocorrelation

get_default_value() - Method in class qsardes.descriptor.qsarme.QsarMEAutocorrelation

get_default_value() - Method in class qsardes.descriptor.qsarwb.QsarWBAutocorrelation

get_descriptor_names() - Method in interface qsardes.descriptor.Descriptor

Gets descriptors names.

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAcgc

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAdjacencyMatrix

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAlogp

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorApol

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAromAtomCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAromBondCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAtomCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorAutocorrelation

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorBasicGroupCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorBcut

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorBondCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorBpol

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorBurdenModifiedEigenvalues

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorCarbonTypes

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorChiChain

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorChiCluster

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorChiPath

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorChiPathCluster

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorConstitutional

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorCrippen

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorDetourMatrix

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorEccentricConnectIndex

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorExtendedTopochemIndex

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintEstate

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintEstateCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintKlekotaRoth

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintKlekotaRothCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintPubchem

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintSubstructure

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFingerprintSubstructureCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFMF

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFractionalCsp3

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFractionalPsa

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorFragmentComplexity

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorHBondAcceptorsCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorHBondDonorsCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorHybridizationRatio

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorInformationContent

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorJplogp

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorKappaShapeIndex

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorLargestChain

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorLargestPiSystem

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorLongestAliphaticChain

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorMannholdLogp

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorMlfer

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorMolecularDistanceEdge

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorPathCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorPetitjeanNumber

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorRingCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorRotatableBondsCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorRuleOfFive

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorSpiroAtomCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorTopological

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorTopologicalDistance

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorTopologicalPolarSurfaceArea

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorVanDerWaalsVolume

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorVertexAdjacencyMatrix

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorWalkCount

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorWeight

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorWeightedPath

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorWienerNumbers

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorXlogp

get_descriptor_names() - Method in class qsardes.descriptor.DescriptorZagrebIndex

get_descriptor_names(IMolecularDescriptor) - Method in class qsardes.cdk.CdkTools

Gets CDK descriptor names.

get_descriptor_names(IMolecularDescriptor, Object[]) - Method in class qsardes.cdk.CdkTools

Gets CDK descriptor names.

get_descriptor_type() - Method in interface qsardes.descriptor.Descriptor

Gets the descriptor class type.

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAcgc

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAdjacencyMatrix

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAlogp

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorApol

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAromAtomCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAromBondCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAtomCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorAutocorrelation

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorBasicGroupCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorBcut

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorBondCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorBpol

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorBurdenModifiedEigenvalues

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorCarbonTypes

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorChiChain

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorChiCluster

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorChiPath

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorChiPathCluster

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorConstitutional

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorCrippen

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorDetourMatrix

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorEccentricConnectIndex

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorExtendedTopochemIndex

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintEstate

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintEstateCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintKlekotaRoth

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintKlekotaRothCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintPubchem

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintSubstructure

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFingerprintSubstructureCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFMF

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFractionalCsp3

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFractionalPsa

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorFragmentComplexity

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorHBondAcceptorsCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorHBondDonorsCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorHybridizationRatio

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorInformationContent

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorJplogp

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorKappaShapeIndex

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorLargestChain

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorLargestPiSystem

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorLongestAliphaticChain

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorMannholdLogp

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorMlfer

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorMolecularDistanceEdge

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorPathCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorPetitjeanNumber

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorRingCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorRotatableBondsCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorRuleOfFive

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorSpiroAtomCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorTopological

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorTopologicalDistance

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorTopologicalPolarSurfaceArea

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorVanDerWaalsVolume

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorVertexAdjacencyMatrix

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorWalkCount

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorWeight

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorWeightedPath

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorWienerNumbers

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorXlogp

get_descriptor_type() - Method in class qsardes.descriptor.DescriptorZagrebIndex

get_descriptor_values(AbstractMoleculeBuilder) - Method in interface qsardes.descriptor.Descriptor

Calculates descriptors values.

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAcgc

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAdjacencyMatrix

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAlogp

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorApol

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAromAtomCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAromBondCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAtomCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorAutocorrelation

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorBasicGroupCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorBcut

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorBondCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorBpol

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorBurdenModifiedEigenvalues

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorCarbonTypes

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorChiChain

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorChiCluster

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorChiPath

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorChiPathCluster

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorConstitutional

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorCrippen

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorDetourMatrix

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorEccentricConnectIndex

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorExtendedTopochemIndex

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintEstate

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintEstateCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintKlekotaRoth

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintKlekotaRothCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintPubchem

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintSubstructure

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFingerprintSubstructureCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFMF

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFractionalCsp3

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFractionalPsa

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorFragmentComplexity

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorHBondAcceptorsCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorHBondDonorsCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorHybridizationRatio

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorInformationContent

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorJplogp

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorKappaShapeIndex

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorLargestChain

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorLargestPiSystem

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorLongestAliphaticChain

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorMannholdLogp

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorMlfer

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorMolecularDistanceEdge

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorPathCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorPetitjeanNumber

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorRingCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorRotatableBondsCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorRuleOfFive

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorSpiroAtomCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorTopological

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorTopologicalDistance

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorTopologicalPolarSurfaceArea

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorVanDerWaalsVolume

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorVertexAdjacencyMatrix

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorWalkCount

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorWeight

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorWeightedPath

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorWienerNumbers

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorXlogp

get_descriptor_values(AbstractMoleculeBuilder) - Method in class qsardes.descriptor.DescriptorZagrebIndex

get_empty_map(IMolecularDescriptor) - Method in class qsardes.cdk.CdkTools

Gets CDK descriptor empty map.

get_eta_eta_b(int, double) - Method in class qsardes.descriptor.DescriptorExtendedTopochemIndex

get_eta_eta_b(int, double) - Method in class qsardes.descriptor.qsarme.QsarMEExtendedTopochemIndex

get_eta_eta_b(int, double) - Method in class qsardes.descriptor.qsarwb.QsarWBExtendedTopochemIndex

get_first_ioniz_potential() - Method in enum class qsardes.elements.ElementsEnum

Gets the first ionization potential.

get_ggi_map() - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_graph() - Method in class qsardes.molecule.AbstractMoleculeBuilder

Gets the directed graph of the molecular representation.

get_graph() - Method in class qsardes.molecule.Molecule

Gets the directed graph of the molecular representation.

get_implicit_hydrogens_count() - Method in class qsardes.molecule.AbstractMoleculeBuilder

get_intrinsic_state(Molecule, IAtom) - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_intrinsic_state(Molecule, IAtom) - Method in class qsardes.descriptor.qsarme.QsarMEElectrTopolStateIndex

get_intrinsic_state(Molecule, IAtom) - Method in class qsardes.descriptor.qsarwb.QsarWBElectrTopolStateIndex

get_jgi_map() - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_jgt_map() - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_mass() - Method in enum class qsardes.elements.ElementsEnum

Gets the atomic mass.

get_max() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_max() - Method in class qsardes.descriptor.qsarme.QsarMEElectrTopolStateIndex

get_max() - Method in class qsardes.descriptor.qsarwb.QsarWBElectrTopolStateIndex

get_max(double[]) - Method in class qsardes.util.UtilsCalc

Gets the biggest value in an array.

get_max(int[]) - Method in class qsardes.util.UtilsCalc

Gets the biggest value in an array.

get_max_estate(double, double, boolean) - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_max_estate(double, double, boolean) - Method in class qsardes.descriptor.qsarme.QsarMEElectrTopolStateIndex

get_max_estate(double, double, boolean) - Method in class qsardes.descriptor.qsarwb.QsarWBElectrTopolStateIndex

get_max_out_map() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_min() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_min() - Method in class qsardes.descriptor.qsarme.QsarMEElectrTopolStateIndex

get_min() - Method in class qsardes.descriptor.qsarwb.QsarWBElectrTopolStateIndex

get_min(double[]) - Method in class qsardes.util.UtilsCalc

Gets the smallest value in an array.

get_min(int[]) - Method in class qsardes.util.UtilsCalc

Gets the smallest value in an array.

get_min_estate(double, double, boolean) - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_min_estate(double, double, boolean) - Method in class qsardes.descriptor.qsarme.QsarMEElectrTopolStateIndex

get_min_estate(double, double, boolean) - Method in class qsardes.descriptor.qsarwb.QsarWBElectrTopolStateIndex

get_min_out_map() - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_mol() - Method in class qsardes.descriptor.DescriptorExtendedTopochemIndex

get_order_list() - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_original_kier_name(String) - Method in class qsardes.descriptor.DescriptorElectrTopolStateIndex

get_pauling_electroneg() - Method in enum class qsardes.elements.ElementsEnum

Gets the Pauling atomic electronegativity.

get_polarizability() - Method in enum class qsardes.elements.ElementsEnum

Gets the atomic polarizability.

get_sanderson_electroneg() - Method in enum class qsardes.elements.ElementsEnum

Gets the Sanderson atomic electronegativity.

get_source() - Method in class qsardes.molecule.CustomEdge

Gets the edge source.

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.DescriptorDetourMatrix

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.DescriptorTopologicalDistance

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.qsarme.QsarMEBaryszMatrix

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.qsarme.QsarMEDetourMatrix

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.qsarme.QsarMETopologicalDistance

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.qsarwb.QsarWBBaryszMatrix

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.qsarwb.QsarWBDetourMatrix

get_sp_ve1_sum(double) - Method in class qsardes.descriptor.qsarwb.QsarWBTopologicalDistance

get_t_ring_set(IAtomContainer) - Method in class qsardes.descriptor.DescriptorRingCount

get_t_ring_set(IAtomContainer) - Method in class qsardes.descriptor.qsarme.QsarMERingCount

get_t_ring_set(IAtomContainer) - Method in class qsardes.descriptor.qsarwb.QsarWBRingCount

get_target() - Method in class qsardes.molecule.CustomEdge

Gets the edge target.

get_topol_charge_index(double[][], int[][]) - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_topol_charge_index(double[][], int[][]) - Method in class qsardes.descriptor.qsarme.QsarMETopologicalCharge

get_topol_charge_index(double[][], int[][]) - Method in class qsardes.descriptor.qsarwb.QsarWBTopologicalCharge

get_tsrw(double) - Method in class qsardes.descriptor.DescriptorWalkCount

get_tsrw(double) - Method in class qsardes.descriptor.qsarme.QsarMEWalkCount

get_tsrw(double) - Method in class qsardes.descriptor.qsarwb.QsarWBWalkCount

get_van_der_waals_radius() - Method in enum class qsardes.elements.ElementsEnum

Gets the van der Waals atomic radius.

get_van_der_waals_volume() - Method in enum class qsardes.elements.ElementsEnum

Gets the van der Waals atomic volume.

get_ve3(double, int) - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_ve3(double, int) - Method in class qsardes.descriptor.DescriptorDetourMatrix

get_ve3(double, int) - Method in class qsardes.descriptor.DescriptorTopologicalDistance

get_ve3(double, int) - Method in class qsardes.descriptor.qsarme.QsarMEBaryszMatrix

get_ve3(double, int) - Method in class qsardes.descriptor.qsarme.QsarMEDetourMatrix

get_ve3(double, int) - Method in class qsardes.descriptor.qsarme.QsarMETopologicalDistance

get_ve3(double, int) - Method in class qsardes.descriptor.qsarwb.QsarWBBaryszMatrix

get_ve3(double, int) - Method in class qsardes.descriptor.qsarwb.QsarWBDetourMatrix

get_ve3(double, int) - Method in class qsardes.descriptor.qsarwb.QsarWBTopologicalDistance

get_vert_num(int[][]) - Method in class qsardes.descriptor.DescriptorTopologicalCharge

get_vert_num(int[][]) - Method in class qsardes.descriptor.qsarme.QsarMETopologicalCharge

get_vert_num(int[][]) - Method in class qsardes.descriptor.qsarwb.QsarWBTopologicalCharge

get_vr3(double, int) - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_vr3(double, int) - Method in class qsardes.descriptor.DescriptorDetourMatrix

get_vr3(double, int) - Method in class qsardes.descriptor.DescriptorTopologicalDistance

get_vr3(double, int) - Method in class qsardes.descriptor.qsarme.QsarMEBaryszMatrix

get_vr3(double, int) - Method in class qsardes.descriptor.qsarme.QsarMEDetourMatrix

get_vr3(double, int) - Method in class qsardes.descriptor.qsarme.QsarMETopologicalDistance

get_vr3(double, int) - Method in class qsardes.descriptor.qsarwb.QsarWBBaryszMatrix

get_vr3(double, int) - Method in class qsardes.descriptor.qsarwb.QsarWBDetourMatrix

get_vr3(double, int) - Method in class qsardes.descriptor.qsarwb.QsarWBTopologicalDistance

get_weights_list() - Method in class qsardes.descriptor.DescriptorAutocorrelation

get_weights_list() - Method in class qsardes.descriptor.DescriptorBaryszMatrix

get_weights_list() - Method in class qsardes.descriptor.DescriptorConstitutional

get_weights_list() - Method in class qsardes.descriptor.qsarme.QsarMEAutocorrelation

get_weights_list() - Method in class qsardes.descriptor.qsarme.QsarMEBaryszMatrix

get_weights_list() - Method in class qsardes.descriptor.qsarme.QsarMEConstitutional

get_weights_list() - Method in class qsardes.descriptor.qsarwb.QsarWBAutocorrelation

get_weights_list() - Method in class qsardes.descriptor.qsarwb.QsarWBBaryszMatrix

get_weights_list() - Method in class qsardes.descriptor.qsarwb.QsarWBConstitutional

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